C122-0267 Screening compound: 4-[(4-CHLOROPHENYL)METHYL]-N-CYCLOPROPYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE-6-CARBOXAMIDE

C122-0267 Screening compound: 4-[(4-CHLOROPHENYL)METHYL]-N-CYCLOPROPYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE-6-CARBOXAMIDE
C122-0267 Screening compound: 4-[(4-CHLOROPHENYL)METHYL]-N-CYCLOPROPYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE-6-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C122-0267
4-[(4-CHLOROPHENYL)METHYL]-N-CYCLOPROPYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE-6-CARBOXAMIDE

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C122-0267

Molecular Formula

C19H17ClN2O2S (C19 H17 ClN2 O2 S)

Compound Name

4-[(4-CHLOROPHENYL)METHYL]-N-CYCLOPROPYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE-6-CARBOXAMIDE

IUPAC name

4-[(4-chlorophenyl)methyl]-N-cyclopropyl-3-oxo-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

O=C(c(cc1)cc(N2Cc(cc3)ccc3Cl)c1SCC2=O)NC1CC1

InChI

InChI=1S/C19H17ClN2O2S/c20-14-4-1-12(2-5-14)10-22-16-9-13(19(24)21-15-6-7-15)3-8-17(16)25-11-18(22)23/h1-5,8-9,15H,6-7,10-11H2,(H,21,24)

InChI Key

KXIDTVCGHAVSPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04062718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.510

Distribution Coefficient, logD

3.510

Water Solubility, LogSw

-4.12

Polar Surface Area

40.089

Acid Dissociation Constant (pKa)

13.13

Base Dissociation Constant (pKb)

-2.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

C122-0267 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with C122-0267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C122-0267?
Check Price and Availability of C122-0267, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C122-0267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C122-0267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C122-0267
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C122-0267 available by request